4-methoxy-N-[(2S)-3-methyl-2-morpholin-4-yl-butyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-[(2S)-3-methyl-2-morpholin-4-yl-butyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-[(2S)-3-methyl-2-morpholino-butyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-[(2S)-3-methyl-2-(4-morpholinyl)butyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-[(2S)-3-methyl-2-morpholin-4-ylbutyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-[(2S)-3-methyl-2-morpholino-butyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H33N3O5S MolecularWeight: 439.56882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC2)N3CCOCC3

Isomeric SMILES

CC(C)[C@@H](CNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCC2)N3CCOCC3

InChI

InChI=1S/C21H33N3O5S/c1-16(2)18(23-10-12-29-13-11-23)15-22-21(25)17-6-7-19(28-3)20(14-17)30(26,27)24-8-4-5-9-24/h6-7,14,16,18H,4-5,8-13,15H2,1-3H3,(H,22,25)/t18-/m1/s1